Glycoside
GD147924
Name:
2-(hydroxymethyl)-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,â´]dec-7-en-5-yl 3-(3,4-dimethoxyphenyl)prop-2-enoateFormula:
C26H32O13Smiles:
COc1ccc(C=CC(=O)OC2C3C=COC(OC4OC(CO)C(O)C(O)C4O)C3C3(CO)OC23)cc1OCAglycone:
COc1ccc(C=CC(=O)OC2C3C=COC(O)C3C3(CO)OC23)cc1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 9 |
| MolWt: | 552.53 | Num_heavy_atoms: | 39 |
| TPSA: | 186.13 | NumAromaticRings: | 1 |
Unique Aglycone
AD59218
Formula: C20H22O8
Smiles:
COc1ccc(C=CC(=O)OC2C3C=COC(O)C3C3(CO)OC23)cc1OC| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 6 |
| MolWt: | 390.39 | Num_heavy_atoms: | 28 |
| TPSA: | 106.98 | NumAromaticRings: | 1 |
